Methyl 3-methoxy-4-methylbenzoate

Basic Information

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CAS Number

3556-83-0

Molecular Formula

C10H12O3

Molecular Weight

180.2 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

50-54 °C

Boiling Point

138-142 ºC (20 Torr)

Refractive Index

1.5295

SMILES

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CC1=C(C=C(C=C1)C(=O)OC)OC

InChI

InChI=1S/C10H12O3/c1-7-4-5-8(10(11)13-3)6-9(7)12-2/h4-6H,1-3H3

InChIKey

LLEXCSBUSVRBCA-UHFFFAOYSA-N

LogP

1.7902200000000001

Topological Polar Surface Area

35.53 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

179

Safety Information

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GHS Hazard Pictograms

H315

H319

H335

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

DTXSID30343639
Methyl3-Methoxy-4-methylbenzoate
Methyl 4-Methyl-m-anisate
SCHEMBL1757167
CS-W010754
Methyl 3-methoxy-4-methylbenzoate, 96%
M1427
J-522192
NF-0026
3-Methoxy-p-toluic Acid Methyl Ester
Methyl 3-methoxy-4-methylbenzoate
3-methoxy-4-methyl-benzoic acid methyl ester
3-Methoxy-4-methylbenzoic Acid Methyl Ester
methyl 4-methyl-3-(methyloxy)benzoate
methyl 3-methoxy-4-methyl-benzoate
AB03124
Methyl 3-Methoxy-p-toluate
FT-0616018
3556-83-0
Benzoic acid, 3-methoxy-4-methyl-, methyl ester
SY021136
AM20040268
Benzoic acid, 4-methyl-3-methoxy, methyl ester
AKOS009039656
MFCD00082710
4-Methyl-m-anisic Acid Methyl Ester
NS00123200
3-Methoxy-4-methylbenzoic acid methyl ester
Methyl-3-methoxy-4-methylbenzoate
3-Methoxy-4-methyl-benzoesaeure-methylester
methyl 3-methoxy-3-methyl benzoate

MDL Number

MFCD00082710

Customs Code

2918990090

FAQ

What is Methyl 3-methoxy-4-methylbenzoate (CAS: 3556-83-0)?

Methyl 3-methoxy-4-methylbenzoate (CAS: 3556-83-0) is a benzoate ester with a molecular formula of C10H12O3. It is a colorless to slightly yellowish liquid with a characteristic odor. This compound is used in various applications such as fragrance ingredients, pharmaceuticals, and research reagents.

What are the main uses of Methyl 3-methoxy-4-methylbenzoate (CAS: 3556-83-0)?

Methyl 3-methoxy-4-methylbenzoate (CAS: 3556-83-0) is widely used in the fragrance and flavor industry as a fragrance compound. It is also employed in pharmaceuticals as a starting material or intermediate, and in research as a reagent.

Is Methyl 3-methoxy-4-methylbenzoate (CAS: 3556-83-0) safe?

Methyl 3-methoxy-4-methylbenzoate (CAS: 3556-83-0) is generally considered safe for its intended uses under proper handling conditions. However, it should be handled with care to avoid skin contact and inhalation. Direct contact with eyes and ingestion should be avoided. Adequate ventilation and protective equipment are recommended.

How should Methyl 3-methoxy-4-methylbenzoate (CAS: 3556-83-0) be stored?

Methyl 3-methoxy-4-methylbenzoate (CAS: 3556-83-0) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a sealed container to maintain its integrity. The storage temperature should be below 30°C, and the relative humidity should be controlled to minimize evaporation and degradation.